source: src/Fragmentation/Automation/VMGDebugGridFragmentController.cpp

Candidate_v1.6.1
Last change on this file was 9eb71b3, checked in by Frederik Heber <frederik.heber@…>, 8 years ago

Commented out MemDebug include and Memory::ignore.

  • MemDebug clashes with various allocation operators that use a specific placement in memory. It is so far not possible to wrap new/delete fully. Hence, we stop this effort which so far has forced us to put ever more includes (with clashes) into MemDebug and thereby bloat compilation time.
  • MemDebug does not add that much usefulness which is not also provided by valgrind.
  • Property mode set to 100644
File size: 1.9 KB
Line 
1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2012 University of Bonn. All rights reserved.
5 *
6 *
7 * This file is part of MoleCuilder.
8 *
9 * MoleCuilder is free software: you can redistribute it and/or modify
10 * it under the terms of the GNU General Public License as published by
11 * the Free Software Foundation, either version 2 of the License, or
12 * (at your option) any later version.
13 *
14 * MoleCuilder is distributed in the hope that it will be useful,
15 * but WITHOUT ANY WARRANTY; without even the implied warranty of
16 * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
17 * GNU General Public License for more details.
18 *
19 * You should have received a copy of the GNU General Public License
20 * along with MoleCuilder. If not, see <http://www.gnu.org/licenses/>.
21 */
22
23/*
24 * VMGDebugGridFragmentController.cpp
25 *
26 * Created on: Aug 27, 2012
27 * Author: heber
28 */
29
30
31// include config.h
32#ifdef HAVE_CONFIG_H
33#include <config.h>
34#endif
35
36// boost asio needs specific operator new
37#include <boost/asio.hpp>
38
39//#include "CodePatterns/MemDebug.hpp"
40
41#include "VMGDebugGridFragmentController.hpp"
42
43#include "Jobs/VMGDebugGridJob.hpp"
44
45bool VMGDebugGridFragmentController::createDebugJobs(
46 const std::vector<SamplingGrid> &full_sampled_grid,
47 const bool _OpenBoundaryConditions)
48{
49 std::vector<FragmentJob::ptr> jobs;
50
51 for(std::vector<SamplingGrid>::const_iterator iter = full_sampled_grid.begin();
52 iter != full_sampled_grid.end();
53 ++iter) {
54 const JobId_t next_id = getAvailableId();
55 LOG(1, "INFO: Creating full VMGDebugGridJob with " << *iter
56 << " gridpoints.");
57 FragmentJob::ptr testJob(
58 new VMGDebugGridJob(next_id, *iter, _OpenBoundaryConditions) );
59 jobs.push_back(testJob);
60 }
61
62 // then send jobs to controller
63 addJobs(jobs);
64 sendJobs(host, port);
65 RunService("Adding VMGDebugGridJobs");
66
67 return true;
68}
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